1-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]butyl]-1,4-diazepan-2-one

Systemtic Name: 1-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]butyl]-1,4-diazepan-2-one Openeye Name: 1-[4-[(7-nitrotetralin-2-yl)-propyl-amino]butyl]-1,4-diazepan-2-one CAS Name: 1-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]butyl]-1,4-diazepan-2-one IUPAC Name: 1-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]butyl]-1,4-diazepan-2-one Traditional Name: 1-[4-[(7-nitrotetralin-2-yl)-propyl-amino]butyl]-1,4-diazepan-2-one Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCCNCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCCCN1CCCNCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H34N4O3/c1-2-11-24(12-3-4-13-25-14-5-10-23-17-22(25)27)20-8-6-18-7-9-21(26(28)29)16-19(18)15-20/h7,9,16,20,23H,2-6,8,10-15,17H2,1H3